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Structure

3-(4-Oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]thieno[2,3-d]pyrimidin-2-yl)-propionic acid

CAS
109164-47-8
Catalog Number
ACM109164478
Category
Other Products
Molecular Weight
278.327
Molecular Formula
C13H14N2O3S

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Specification

Synonyms
109164-47-8, F0307-0537, [1]Benzothieno[2,3-d]pyrimidine-2-propanoicacid, 1,4,5,6,7,8-hexahydro-4-oxo-, 3-(4-Oxo-3,4,5,6,7,8-hexahydro-benzo[4,5]thieno[2,3-d]pyrimidin-2-yl)-propionic acid, 3-(4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)propanoic acid, IFLab1_001277, ACMC-20mc2u, AC1LF1ZV, AC1Q75AG, AC1Q75AH, Oprea1_089649, CBDivE_002586, SureCN12280662, CTK0H2752, MolPort-001-833-724, HMS1415K01, AKOS002085626, AKOS002665078, AG-D-25932, CCG-199306
IUPAC Name
3-(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)propanoic acid
Canonical SMILES
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)CCC(=O)O
InChI Key
ZUYIZUTYDFCUMM-UHFFFAOYSA-N
Boiling Point
470.6ºC at 760 mmHg
Flash Point
238.4ºC
Density
1.61g/cm³
Exact Mass
278.07300
H-Bond Acceptor
5
H-Bond Donor
2
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